Match Eigenvalues sum
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run cuda-serial: [foss2022a-cuda-mpi] >
Input 31-acetylene_b3lyp.01-gs.inp
| Value | Reference | Precision | Status |
| -4.815992610000000e+00 | -4.815992680000000e+00 | 4.620000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Eigenvalues =', 3)